Benoxaprofen
TL;DR: Benoxaprofen (CAS 51234-28-7) is a chemical compound with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoic acid
Also Known As: Benoxaprofen, Oraflex, Coxigon, Uniprofen, Opren
| Molecular Formula | C16H12ClNO3 |
|---|---|
| Molecular Weight | 301.05 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.05057 |
| Heavy Atoms | 21 |
| Complexity | 384.0 |
| Melting Point | 196 |
Chemical Identifiers
| CAS Number | 51234-28-7 |
|---|---|
| SMILES | CC(C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)Cl)C(=O)O |
| InChIKey | MITFXPHMIHQXPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benoxaprofen (CAS 51234-28-7), with molecular formula C16H12ClNO3 and molecular weight 301.05 g/mol. IUPAC: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]propanoic acid.
Chemical Property Profile of Benoxaprofen
Property Insights of Benoxaprofen
The XLogP value of 4.1 indicates that Benoxaprofen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Benoxaprofen. Following Lipinski's Rule of Five, Benoxaprofen has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benoxaprofen?
The CAS number of Benoxaprofen is 51234-28-7.
What is the molecular formula of Benoxaprofen?
The molecular formula of Benoxaprofen is C16H12ClNO3.
What is the molecular weight of Benoxaprofen?
The molecular weight of Benoxaprofen is 301.05 g/mol.
Where can I buy Benoxaprofen?
You can request a quote for Benoxaprofen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benoxaprofen?
Yes, KEHONG BIO provides custom synthesis services for Benoxaprofen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.